ethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-6-(2-nitrophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-6-(2-nitrophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(3-chloro-4-fluoro-phenyl)-4-methyl-6-(2-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(3-chloro-4-fluorophenyl)-4-methyl-6-(2-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-chloro-4-fluorophenyl)-4-methyl-6-(2-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-keto-4-methyl-6-(2-nitrophenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H17ClFN3O5 MolecularWeight: 433.817483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2[N+](=O)[O-])C3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2[N+](=O)[O-])C3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C20H17ClFN3O5/c1-3-30-19(26)17-11(2)24(12-8-9-15(22)14(21)10-12)20(27)23-18(17)13-6-4-5-7-16(13)25(28)29/h4-10,18H,3H2,1-2H3,(H,23,27)